BDBM50044562 CHEMBL3341914

SMILES: CC1=CC(=O)N(Nc2ncc(-c3coc(C)n3)c(n2)-c2cccs2)C1=O

InChI Key: InChIKey=RHBTWDFORLRVLM-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50044562   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Transcription factor AP-1 (Homo sapiens (Human))	BDBM50044562 (CHEMBL3341914) Show SMILES CC1=CC(=O)N(Nc2ncc(-c3coc(C)n3)c(n2)-c2cccs2)C1=O |t:1| Show InChI InChI=1S/C17H13N5O3S/c1-9-6-14(23)22(16(9)24)21-17-18-7-11(12-8-25-10(2)19-12)15(20-17)13-4-3-5-26-13/h3-8H,1-2H3,(H,18,20,21)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	760	n/a	n/a	n/a	n/a	n/a	n/a
University of Texas Medical Branch Curated by ChEMBL					Assay Description Inhibition of AP-1-mediated transcriptional activation in human Jurkat cells by luciferase reporter gene assay				J Med Chem 57: 6930-48 (2014) Article DOI: 10.1021/jm5004733 BindingDB Entry DOI: 10.7270/Q2222WDT
					More data for this Ligand-Target Pair